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Compound Detail

CHEMBL329654

SODIUM METHYL (BENZYLOXY)CARBONYLPHOSPHONATE
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COP(=O)([O-])C(=O)OCc1ccccc1.[Na+]
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL329654
Name SODIUM METHYL (BENZYLOXY)CARBONYLPHOSPHONATE
Phase Preclinical
Structure Type MOL
InChI Key PTLYWFMPCOFHDO-UHFFFAOYSA-M
Parent Compound CHEMBL1206962
Active Moiety CHEMBL1206962
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

230.2
MW (Da)
2.15
ALogP
4
HBA
1
HBD
72.8
PSA (Ų)
0.80
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H10NaO5P
MW 252.14
Aromatic Rings 1
Heavy Atoms 15
NP-Likeness -0.08

Literature References

PubMed DOI Target Context # Activities
6298425 10.1021/jm00356a028 DNA polymerase catalytic subunit 1
6298425 10.1021/jm00356a028 Human alphaherpesvirus 1 1

Data from ChEMBL 36 via Core Engine